%chk=000213519.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213519

0 1
P 3.369082 0.153092 -0.473069
O 4.093904 0.287301 1.010213
O 3.299665 -1.444179 -0.726007
O 3.948950 0.900270 -1.594112
O 0.405499 -0.527651 -1.208127
O -5.838378 0.044547 0.159568
N 1.807766 0.734051 0.127808
N -0.491068 1.269147 0.003293
N -2.164172 -0.445977 0.223935
N -2.770673 1.904046 -0.112712
C 5.501233 0.648484 1.031103
C 2.527482 -2.278885 0.199152
C 0.566563 0.392790 -0.440790
C 5.719661 2.095843 0.635613
C 3.261549 -3.604927 0.185863
C -1.849389 0.871932 0.017404
C -4.477788 0.220667 0.130784
C -3.484063 -0.763896 0.267958
C -4.071655 1.572396 -0.050135
C -6.319611 -1.317371 0.290014
H 1.822120 1.377549 0.941862
H 5.740196 0.467804 2.100315
H 6.078118 -0.056412 0.403149
H 2.484506 -1.833396 1.208515
H 1.510916 -2.349033 -0.248252
H 5.034642 2.770902 1.163181
H 5.568002 2.263010 -0.446160
H 6.742407 2.418600 0.864766
H 3.497367 -3.901598 -0.848801
H 4.216506 -3.550149 0.721896
H 2.658133 -4.402451 0.633526
H -0.324834 2.282146 0.038367
H -3.713622 -1.824221 0.420120
H -4.814386 2.374998 -0.148646
H -5.986719 -1.924103 -0.557056
H -7.407822 -1.166890 0.260130
H -6.010187 -1.740937 1.249432


%chk=000213519-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213519

0 1
P 3.330844 0.117468 -0.450790
O 4.170625 0.650158 0.979265
O 3.505889 -1.587497 -0.516626
O 3.782311 0.798189 -1.807359
O 0.387802 -0.834354 -1.055363
O -5.996031 0.261189 0.131849
N 1.768940 0.526966 0.261862
N -0.523492 0.925846 0.258688
N -2.356010 -0.605486 0.049644
N -2.681278 1.787113 0.394419
C 5.619157 0.999211 0.859654
C 2.806667 -2.480872 0.461896
C 0.517074 0.116336 -0.247817
C 5.804084 2.454691 0.423502
C 3.383393 -3.873874 0.229630
C -1.904675 0.664111 0.213747
C -4.604933 0.321285 0.158717
C -3.711107 -0.769103 0.010803
C -4.022347 1.601359 0.372576
C -6.606671 -1.057111 -0.097126
H 1.828107 1.107480 1.104215
H 6.009464 0.816639 1.874857
H 6.112525 0.303128 0.154896
H 3.000194 -2.120224 1.490746
H 1.725638 -2.441020 0.240573
H 5.285501 3.139150 1.117374
H 5.409782 2.607031 -0.595368
H 6.880169 2.712430 0.425482
H 3.214656 -4.187819 -0.813880
H 4.467701 -3.893264 0.431916
H 2.885119 -4.599750 0.899070
H -0.307946 1.887006 0.536761
H -4.059419 -1.797271 -0.129708
H -4.660516 2.478034 0.522494
H -6.293426 -1.475873 -1.072435
H -7.689885 -0.871616 -0.099978
H -6.348009 -1.762186 0.715914


